| CAS Number | 1423358-94-4 |
| Catalog Number | AG01A3PZ |
| Chemical Name | Methyl 2-(3-bromophenyl)-2-(methylamino)acetate hydrochloride |
| IUPAC Name | methyl 2-(3-bromophenyl)-2-(methylamino)acetate;hydrochloride |
| InChI | InChI=1S/C10H12BrNO2.ClH/c1-12-9(10(13)14-2)7-4-3-5-8(11)6-7;/h3-6,9,12H,1-2H3;1H |
| InChI Key | VRTCIUWLWNDQJY-UHFFFAOYSA-N |
| MDL Number | MFCD23144061 |
| Molecular Formula | C10H13BrClNO2 |
| Molecular Weight | 294.5727 |
| SMILES | Cl.CNC(C1=CC(Br)=CC=C1)C(OC)=O |
| Synonyms | methyl 2-(3-bromophenyl)-2-(methylamino)acetate hydrochloride,
1423358-94-4,
MCULE-3161121565,
NE17042,
Z1552027585,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.982g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 294.573g/mol |
| Monoisotopic Mass | 292.982g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number